1-(2-oxidanyl-4-phenylmethoxy-phenyl)octan-1-one

Systemtic Name: 1-(2-oxidanyl-4-phenylmethoxy-phenyl)octan-1-one Openeye Name: 1-(4-benzyloxy-2-hydroxy-phenyl)octan-1-one CAS Name: 1-(2-hydroxy-4-phenylmethoxyphenyl)-1-octanone IUPAC Name: 1-(2-hydroxy-4-phenylmethoxyphenyl)octan-1-one Traditional Name: 1-(4-benzoxy-2-hydroxy-phenyl)octan-1-one Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)O

InChI

InChI=1S/C21H26O3/c1-2-3-4-5-9-12-20(22)19-14-13-18(15-21(19)23)24-16-17-10-7-6-8-11-17/h6-8,10-11,13-15,23H,2-5,9,12,16H2,1H3